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51Â¥2012-12-01 10:54:15
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Ͷ¸åÔÓÖ¾Ãû³Æ£ºInternational Journal of Molecular Sciences
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Reviewer 1#
1) This paper is well organized and of interest in the field, but some points must be clarified and discussed before it can be suitable of publication.
2) On page 3, line 113: "required empirical potential energy function" must be substituted with "force field parameters" since the term is wrong.
A question on page 4 paragraph lines 118-121: How can the authors be sure that the most conformational analysis been made on each of these tow compounds? This point of course is crucial for a correct alignment and thus further analysis.
3) On page 7, another perplexity: How can the authors be sure that the crystallized water are indeed structural for the template protein too? Are there any experimental evidence? I suggest to repeat the docking calculations also in absence of water inside the cleft and tentatively compare the results obtained. This point of is crucial since all the discussion about the molecular interactions is linked to structural water playing a fundamental role in stabilization.
4) On page 11, figure 5: line 322-323: "tubes" instead of "ball and stick".

Reviewer 1#
Considering the situation that no X-ray structure of human proteasome exists, making good models of the enzyme as inhibitor-bound form help researchers conduct SAR study efficiently. The computational studies in this manuscript almost meet the demand. However, both compounds dealt with in this manuscript are covalent inhibitors. The reviewer would like the authors to state any good reason why only non-covalent interactions were considered in the calculations. Especially, TBA is believed to make reversible borate adduct form to display proteasome-inhibitory activity, and the bound structure should be more suitable to evaluate results from SAR studies on the compounds of this class. Recalculations is requested if needed.
On the top of that, the following should be considered.
Line 68: What abbreviation MM means (multiple myeloma) should be indicated.
Line 101: "selected considered having a similar range" is grammatically incorrect.
Line 227: change energy to energetically
throuout: Usually, "big" is not used scientific articles like this. Change to large, bulky or other appropriate words.
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[ Last edited by zhtear99 on 2012-12-1 at 14:50 ]
52Â¥2012-12-01 14:41:40
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zhtear99: ½ð±Ò+15, ¸ÐлÀ´¸å~~~ 2012-12-02 12:37:16
zhtear99: »ØÌûÖö¥ 2012-12-02 12:37:18
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Reviewer A:

Comments for Reviewer's Assessment:
        The quality of English writing is very poor and the document must be
revised by an native english speaking person. See my remarks in the enclosed
file.

Comments for the Authors:
        Interesting paper with a good patent review. The document requires major modifications and answers to my remarks as proposed in the enclosed file.

Reviewer B:

Comments for Reviewer's Assessment:
        The authors review approaches for addressing naphthenic acid corrosion, including usage of inhibitors, solvent extraction, chemical conversion, thermal treatment, and hydrotreatment.  The review covers an important topic that will be of interest to the journals' readership and focuses upon patents between 2000 and 2011.  Whilst the manuscript provides a summary of the methods employed, it does not provide much detail, making it harder for the reader to evaluate the advantages and disadvantages of each.  The reviewer would recommend providing some additional description to strengthen the manuscript.
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